Ascochitine
HIT219251559
sdf文件结构编辑类似物检索
HIT ID: HIT219251559
Cas No: 3615-05-2
分子式: C15H16O5
分子量: 276.288
常用名: Ascochitine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-[(2S)-butan-2-yl]-8-hydroxy-4-methyl-6-oxo-6H-isochromene-7-carboxylic acid
IUPAC: 3-[(2S)-butan-2-yl]-8-hydroxy-4-methyl-6-oxo-6H-isochromene-7-carboxylic acid
SMILES: CC[C@H](C)c1occ2c(O)c(C(O)=O)c(=O)cc2c1C
SMILES: CC[C@H](C)c1occ2c(O)c(C(O)=O)c(=O)cc2c1C
InChI key: DZBCEUTUWOWUDY-ZETCQYMHSA-N
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SC
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